5-Oxo-5-(3-Oxo-3,4-Dihydro-2 H-Quinoxalin-1-Yl)-Pentanoic Acid
[CAS# 436088-60-7]

Identification

• Name: 5-Oxo-5-(3-Oxo-3,4-Dihydro-2 H-Quinoxalin-1-Yl)-Pentanoic Acid
• Synonyms: 5-Keto-5-(3-Keto-2,4-Dihydroquinoxalin-1-Yl)Valerate; Zinc04298347
• Molecular Formula: C₁₃H₁₃N₂O₄
• Molecular Weight: 261.26
• CAS Registry Number: 436088-60-7
• SMILES: C1=CC=CC2=C1N(C(=O)CCCC([O-])=O)CC(=O)N2
• InChI: 1S/C13H14N2O4/c16-11-8-15(12(17)6-3-7-13(18)19)10-5-2-1-4-9(10)14-11/h1-2,4-5H,3,6-8H2,(H,14,16)(H,18,19)/p-1
• InChIKey: PYBOGZOEUKPEOT-UHFFFAOYSA-M

Properties

• Boiling point: 638.536°C at 760 mmHg (Cal.)
• Flash point: 339.974°C (Cal.)